2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide

C23H21NO3 — CID 173271039

IUPAC2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide
SMILESCOCCc1cccc2c1-c1ccccc1C(c1ccccc1C(N)=O)O2
InChIInChI=1S/C23H21NO3/c1-26-14-13-15-7-6-12-20-21(15)16-8-2-3-9-17(16)22(27-20)18-10-4-5-11-19(18)23(24)25/h2-12,22H,13-14H2,1H3,(H2,24,25)
InChIKeyVSKHIKBXLQOMEZ-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.12
Rot. Bonds5

About 2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide

2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide (PubChem CID 173271039) has the molecular formula C23H21NO3 and a molecular weight of 359.43 g/mol. Its IUPAC name is 2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide.

Molecular Properties

Compound Name2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide
PubChem CID173271039
Molecular FormulaC23H21NO3
Molecular Weight359.43 g/mol
Exact Mass359.15
IUPAC Name2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide
SMILESCOCCc1cccc2c1-c1ccccc1C(c1ccccc1C(N)=O)O2
InChIInChI=1S/C23H21NO3/c1-26-14-13-15-7-6-12-20-21(15)16-8-2-3-9-17(16)22(27-20)18-10-4-5-11-19(18)23(24)25/h2-12,22H,13-14H2,1H3,(H2,24,25)
InChIKeyVSKHIKBXLQOMEZ-UHFFFAOYSA-N
XLogP4.12
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-bis(2-methoxyethyl)benzamide
CID 140931342
3-[6-(trifluoromethyl)-6H-benzo[c]chromen-1-yl]propanoic acid
CID 150831778
2-[2-(methoxymethyl)phenyl]benzamide
CID 130398791
2-[[2-(2-methoxyethyl)anilino]methyl]benzoic acid
CID 103268818
2-(2-pentylphenyl)benzamide
CID 174986965
2-[2-amino-3-(2-methoxyethyl)phenyl]benzaldehyde
CID 154402292
2-(3,6-dihexoxy-9H-xanthen-9-yl)benzamide
CID 56973697
2-butylbenzamide
CID 15468173
2-amino-3-(2-methoxyethyl)benzenethiol
CID 102908639
2-amino-3-[2-(2-methoxyethyl)anilino]benzoic acid
CID 102907729
2-(2-phenoxyethyl)benzamide
CID 68945309
2,3-dihydroxy-N-[2-(2-methoxyethyl)phenyl]benzamide
CID 102906466

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide?
The IUPAC name of 2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide (CID 173271039) is 2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide.
What is the SMILES notation for 2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide?
The canonical SMILES for 2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide is COCCc1cccc2c1-c1ccccc1C(c1ccccc1C(N)=O)O2.
What is the InChIKey of 2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide?
The InChIKey is VSKHIKBXLQOMEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO3/c1-26-14-13-15-7-6-12-20-21(15)16-8-2-3-9-17(16)22(27-20)18-10-4-5-11-19(18)23(24)25/h2-12,22H,13-14H2,1H3,(H2,24,25).
What are the key properties of 2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide?
2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide has a molecular weight of 359.43 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methoxyethyl)-6H-benzo[c]chromen-6-yl]benzamide is sourced from PubChem (CID 173271039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).